2-[(4-chlorophenyl)methylsulfanyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinoline-3-carbonitrile

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinoline-3-carbonitrile Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile CAS Name: 2-[(4-chlorophenyl)methylthio]-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-7,7-dimethyl-5-oxo-6,8-dihydroquinoline-3-carbonitrile Traditional Name: 2-[(4-chlorobenzyl)thio]-5-keto-7,7-dimethyl-6,8-dihydroquinoline-3-carbonitrile Formula: C19H17ClN2OS MolecularWeight: 356.86908

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=C(C(=N2)SCC3=CC=C(C=C3)Cl)C#N)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C=C(C(=N2)SCC3=CC=C(C=C3)Cl)C#N)C(=O)C1)C

InChI

InChI=1S/C19H17ClN2OS/c1-19(2)8-16-15(17(23)9-19)7-13(10-21)18(22-16)24-11-12-3-5-14(20)6-4-12/h3-7H,8-9,11H2,1-2H3